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cis-b-Methylstyrene (Stablized with TBC)

CAT: 0572-TRC-C475838-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-C475838-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
766-90-5
Hazard Statement
Flammable liquid and vapour; UN number: UN1993; Packing Group: III
Purity
>95% (GC)
Smiles
C\C=C/c1ccccc1
Molecular Formula
C9H10
Molecular Weight
118.17
Shipping Conditions
Ice Packs
Storage Conditions
+4°C

Chemical Information

beta-Methylstyrene, cis-

cis-beta-methylstyrene has been reported in Actaea simplex with data available.

CAS Number766-90-5
PubChem CID252324
IUPAC Name[(Z)-prop-1-enyl]benzene
Molecular FormulaC9H10
Molecular Weight118.18
XLogP3.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity86
SMILES
C/C=C\C1=CC=CC=C1
InChI
InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2-
InChIKey
QROGIFZRVHSFLM-KXFIGUGUSA-N
Chemical Structure
2D Structure
2D structure of beta-Methylstyrene, cis-
CAS: 766-90-5
CID: 252324
Formula: C9H10
MW: 118.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight118.18
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass118.078250319
Monoisotopic Mass118.078250319
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity86.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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